16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=91.69672810195621 stress="-2872.052085826851 295.4096877343514 225.76007700866717 295.4096877343514 -2375.4251817147815 -194.99473621447305 225.76007700866717 -194.99473621447305 -2799.329566325284" pbc="F F F" Ca -0.08129564 0.04860922 0.20118821 -53.71996237 -37.46926066 -48.16234697 Ca 1.70960170 1.31143450 1.33833517 -234.85544383 406.39316403 29.98693207 Ca 2.78829595 -0.16490224 0.14041416 188.89978252 -284.42856714 -228.34141534 Ca 4.27812781 1.79098848 1.26215777 235.33148151 -161.20426697 95.40519736 Ca -0.12320595 2.95894820 0.20259391 -100.70046173 -68.19090833 -69.32728332 Ca 1.56504129 4.20865944 1.36550211 -343.10041788 489.42212395 144.23928974 Ca 2.78802619 3.22277084 0.18584377 193.89241951 -36.27766227 -513.18828431 Ca 4.40955323 4.48086654 1.83050726 141.53129621 119.15828752 -144.78050039 Ca 0.26959405 0.17626233 2.85402479 -184.23229307 -83.53726689 141.95775193 Ca 1.91285063 1.57550460 4.65300231 -70.46570373 -31.91854501 117.72542161 Ca 2.83433719 -0.04225341 2.91852158 166.17072454 -181.46374593 80.45811566 Ca 4.45789336 1.38825682 4.27041603 44.25935070 19.87314515 20.53082326 Ca 0.19178619 3.17895518 3.29140871 -178.86043049 -117.28615974 -55.83873281 Ca 1.61455359 4.53253581 4.64904689 22.70456684 155.87805962 172.68592447 Ca 2.78091226 3.10609294 2.96603997 86.31497596 -254.40017455 108.90412550 Ca 4.25407479 4.54252089 4.33545096 86.83011530 65.45177722 147.74498154